%chk=000214426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214426

0 1
O -0.007138 1.303242 -0.267906
O 5.674809 -0.862117 -2.270373
O 3.647221 1.415259 3.060032
N 3.075870 0.834679 -0.526690
N 0.174531 -0.401659 -1.757444
C 4.475638 0.835780 -1.048672
C 2.938093 1.573718 0.763239
C 2.091946 1.302873 -1.551106
C 4.971013 -0.635313 -1.027497
C 3.339164 0.610811 1.909581
C 0.777788 0.663648 -1.257707
C 6.001113 -0.895182 0.060780
C 2.259944 -0.411989 2.225405
C -1.180136 0.529167 -0.180389
C -1.069976 -0.518516 -1.082625
C -2.170323 1.008703 0.767367
C -1.986087 -1.620482 -1.372003
C -3.538740 0.802321 0.519323
C -1.763256 1.687944 1.929579
C -2.134243 -2.084409 -2.690271
C -2.711167 -2.226981 -0.331706
C -4.486507 1.262583 1.435744
C -2.718938 2.145366 2.838796
C -3.013833 -3.134461 -2.963668
C -3.587368 -3.276885 -0.614750
C -4.079883 1.931831 2.594992
C -3.742903 -3.729797 -1.929155
H 4.557761 1.225661 -2.085647
H 5.149947 1.483726 -0.449499
H 3.564247 2.490045 0.824792
H 1.885525 1.906435 0.903252
H 2.423145 0.971761 -2.568346
H 1.971574 2.410972 -1.592901
H 4.115818 -1.345666 -0.962993
H 4.328035 0.121273 1.702205
H 5.611622 -0.606629 1.051292
H 6.927570 -0.335606 -0.125145
H 6.280849 -1.955269 0.095539
H 2.065361 -1.044865 1.345161
H 1.304877 0.047872 2.498166
H 2.561794 -1.068754 3.049506
H 5.059830 -1.156328 -2.964738
H 2.841208 1.741925 3.497512
H -3.858058 0.287076 -0.388214
H -0.702081 1.856491 2.110503
H -1.552594 -1.627319 -3.492265
H -2.583232 -1.884492 0.694762
H -5.546851 1.101179 1.243931
H -2.403592 2.670385 3.739462
H -3.128161 -3.492024 -3.985900
H -4.147477 -3.746633 0.192187
H -4.823026 2.288716 3.306593
H -4.426925 -4.548164 -2.145791


%chk=000214426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214426

0 1
O -0.013055 1.412655 -0.116260
O 6.117001 -0.424708 -2.359337
O 3.624064 1.516864 3.358819
N 3.202013 0.989295 -0.370258
N 0.300481 -0.337485 -1.538466
C 4.557578 0.868218 -0.947651
C 3.138428 1.680180 0.940101
C 2.163167 1.397447 -1.348459
C 4.783399 -0.459070 -1.718456
C 3.396137 0.720686 2.130840
C 0.829151 0.776233 -1.060088
C 4.780644 -1.687978 -0.811007
C 2.276653 -0.311824 2.321454
C -1.173334 0.584810 -0.031124
C -0.960116 -0.499853 -0.892631
C -2.249371 1.093090 0.824225
C -1.755458 -1.712522 -1.164098
C -3.614906 0.806275 0.541990
C -1.941185 1.928458 1.935624
C -1.586287 -2.378629 -2.409170
C -2.644866 -2.270688 -0.204992
C -4.637423 1.323238 1.363184
C -2.968065 2.444769 2.751970
C -2.311027 -3.553064 -2.699332
C -3.365976 -3.447313 -0.497134
C -4.321416 2.140621 2.474375
C -3.209120 -4.090714 -1.747562
H 4.792410 1.726316 -1.631343
H 5.298092 0.909551 -0.128293
H 3.875285 2.512635 1.009213
H 2.131907 2.126249 1.060292
H 2.461514 1.042760 -2.348987
H 2.046250 2.505261 -1.404332
H 3.996779 -0.572788 -2.497344
H 4.362470 0.207413 1.981152
H 3.821486 -1.749586 -0.269833
H 5.608193 -1.622218 -0.081463
H 4.917426 -2.606053 -1.406933
H 2.132043 -0.890449 1.392210
H 1.315735 0.187276 2.561758
H 2.522728 -1.007047 3.142341
H 6.162161 0.353336 -2.973037
H 2.751465 1.872896 3.667363
H -3.873658 0.196349 -0.329052
H -0.894687 2.170609 2.147674
H -0.874479 -1.966306 -3.130985
H -2.754933 -1.800333 0.777633
H -5.683421 1.097031 1.128836
H -2.713751 3.083707 3.604861
H -2.172757 -4.051748 -3.665123
H -4.041654 -3.868759 0.255580
H -5.118934 2.540966 3.109645
H -3.770980 -5.004152 -1.972090


